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2-[2-(4-bromo-phenyl)-2-oxo-ethylsulfanyl]-benzoic acid
SpectraBase Compound ID LrCOEaPPFWw
InChI InChI=1S/C15H11BrO3S/c16-11-7-5-10(6-8-11)13(17)9-20-14-4-2-1-3-12(14)15(18)19/h1-8H,9H2,(H,18,19)
InChIKey VDMFLVMQHQPVAU-UHFFFAOYSA-N
Mol Weight 351.21 g/mol
Molecular Formula C15H11BrO3S
Exact Mass 349.961228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F683eL2v8vx
Name 2-[2-(4-bromo-phenyl)-2-oxo-ethylsulfanyl]-benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H11BrO3S
InChI InChI=1S/C15H11BrO3S/c16-11-7-5-10(6-8-11)13(17)9-20-14-4-2-1-3-12(14)15(18)19/h1-8H,9H2,(H,18,19)
InChIKey VDMFLVMQHQPVAU-UHFFFAOYSA-N
Molecular Weight 351.214 g/mol
SMILES OC(c1c(SCC(c2ccc(Br)cc2)=O)cccc1)=O
SPLASH splash10-0uei-5911000000-10fd0467c222c121494b
Synonyms 2-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]sulfanylbenzoic acid 2-[[2-(4-bromophenyl)-2-keto-ethyl]thio]benzoic acid 2-[[2-(4-bromophenyl)-2-oxoethyl]thio]benzoic acid 2-[2-(4-bromophenyl)-2-oxoethyl]sulfanylbenzoic acid
Wiley ID 1456330